7T08
Cryptococcus neoformans protein farnesyltransferase in complex with FPP and inhibitor 2q
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-02-08 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 141.915, 141.915, 130.226 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.170 - 1.803 |
R-factor | 0.1761 |
Rwork | 0.175 |
R-free | 0.19360 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3sfx |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.170 | 1.868 |
High resolution limit [Å] | 1.803 | 1.803 |
Rmerge | 0.158 | 0.603 |
Rmeas | 0.172 | 0.656 |
Rpim | 0.067 | 0.254 |
Number of reflections | 120525 | 10862 |
<I/σ(I)> | 6.79 | 1.91 |
Completeness [%] | 98.7 | 90.05 |
Redundancy | 6.4 | 6.5 |
CC(1/2) | 0.984 | 0.952 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 290 | 100mM CAPSO pH9.5, 50-75mM Li2SO4, 200mM NaCl, 16%-21% PEG4000 |